Details
Stereochemistry | RACEMIC |
Molecular Formula | C19H24N2S.C14H10O4 |
Molecular Weight | 554.699 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
Stereo Comments | C19H24N2S |
SHOW SMILES / InChI
SMILES
OC(=O)C1=CC=CC=C1C(=O)C2=CC=C(O)C=C2.CCN(CC)C(C)CN3C4=CC=CC=C4SC5=C3C=CC=C5
InChI
InChIKey=MJRQYMOUGYDNHE-UHFFFAOYSA-N
InChI=1S/C19H24N2S.C14H10O4/c1-4-20(5-2)15(3)14-21-16-10-6-8-12-18(16)22-19-13-9-7-11-17(19)21;15-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)14(17)18/h6-13,15H,4-5,14H2,1-3H3;1-8,15H,(H,17,18)
Molecular Formula | C19H24N2S |
Molecular Weight | 312.472 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Molecular Formula | C14H10O4 |
Molecular Weight | 242.2268 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:09:44 UTC 2023
by
admin
on
Sat Dec 16 11:09:44 UTC 2023
|
Record UNII |
K9CM14VTI2
|
Record Status |
Validated (UNII)
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Record Version |
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-
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CHEMBL1206
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SUB130477
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11954330
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K9CM14VTI2
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admin on Sat Dec 16 11:09:45 UTC 2023 , Edited by admin on Sat Dec 16 11:09:45 UTC 2023
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100000156554
Created by
admin on Sat Dec 16 11:09:45 UTC 2023 , Edited by admin on Sat Dec 16 11:09:45 UTC 2023
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ACTIVE MOIETY |